(5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol

C12H16O4 — CID 70798995

IUPAC(5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol
SMILESCC1(c2ccccc2)O[C@H](CO)C(O)C1O
InChIInChI=1S/C12H16O4/c1-12(8-5-3-2-4-6-8)11(15)10(14)9(7-13)16-12/h2-6,9-11,13-15H,7H2,1H3/t9-,10?,11?,12?/m1/s1
InChIKeyDMBGVPUTECWHBT-QBWABLMJSA-N
MW224.26 g/mol
LogP0.01
Rot. Bonds2

About (5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol

(5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol (PubChem CID 70798995) has the molecular formula C12H16O4 and a molecular weight of 224.26 g/mol. Its IUPAC name is (5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol.

Molecular Properties

Compound Name(5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol
PubChem CID70798995
Molecular FormulaC12H16O4
Molecular Weight224.26 g/mol
Exact Mass224.10
IUPAC Name(5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol
SMILESCC1(c2ccccc2)O[C@H](CO)C(O)C1O
InChIInChI=1S/C12H16O4/c1-12(8-5-3-2-4-6-8)11(15)10(14)9(7-13)16-12/h2-6,9-11,13-15H,7H2,1H3/t9-,10?,11?,12?/m1/s1
InChIKeyDMBGVPUTECWHBT-QBWABLMJSA-N
XLogP0.01
TPSA69.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3-phenyloxane-2,3,4,5-tetrol
CID 57135995
(2S,3R,4S,5S,6R)-2-(5-benzyl-2-methylphenyl)-6-(hydroxymethyl)-2-methyloxane-3,4,5-triol
CID 59460347
(3S,4R,5S)-2-benzyl-5-(hydroxymethyl)oxolane-2,3,4-triol
CID 142629851
(2S,4R,5R)-5-(hydroxymethyl)-2-methyloxolane-2,3,4-triol
CID 57267196
(3R,4S,5R)-2-amino-5-(hydroxymethyl)-2-methyloxolane-3,4-diol
CID 57244459
(3S,4S,5R)-5-(hydroxymethyl)-2-nitro-2-phenoxyoxolane-3,4-diol
CID 67760147
(2R,3R)-2-methyl-2,3-diphenyloxirane
CID 11031103
(5S)-6-(hydroxymethyl)-2,2-dimethyloxane-3,4,5-triol
CID 163493374
(2R,3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol;(3S,4S,5R)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol
CID 174522323
(2R,3R,4R,5R,6R)-6-(hydroxymethyl)-4-phenyloxane-2,3,4,5-tetrol
CID 125489858
[(4S,5S)-5-benzyl-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
CID 118379229
(5-benzyl-2,2-dimethyl-1,3-dioxolan-4-yl)methanol
CID 123528686

Frequently Asked Questions

What is the IUPAC name of (5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol?
The IUPAC name of (5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol (CID 70798995) is (5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol.
What is the SMILES notation for (5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol?
The canonical SMILES for (5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol is CC1(c2ccccc2)O[C@H](CO)C(O)C1O.
What is the InChIKey of (5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol?
The InChIKey is DMBGVPUTECWHBT-QBWABLMJSA-N. The full InChI is InChI=1S/C12H16O4/c1-12(8-5-3-2-4-6-8)11(15)10(14)9(7-13)16-12/h2-6,9-11,13-15H,7H2,1H3/t9-,10?,11?,12?/m1/s1.
What are the key properties of (5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol?
(5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol has a molecular weight of 224.26 g/mol, XLogP of 0.01, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(hydroxymethyl)-2-methyl-2-phenyloxolane-3,4-diol is sourced from PubChem (CID 70798995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).